==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 21-SEP-12 4H86 . COMPND 2 MOLECULE: PEROXIREDOXIN TYPE-2; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR M.LIU,F.WANG,R.QIU,T.WU,S.GU,R.TANG,C.JI . 187 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9393.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 117 62.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 6.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 32 17.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 7 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 34 18.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 3 0 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 0 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 -10 A G 0 0 121 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-175.9 109.4 107.1 88.6 2 -9 A L + 0 0 155 1,-0.2 0, 0.0 2,-0.0 0, 0.0 0.919 360.0 35.4 -67.2 -45.0 107.9 103.7 88.1 3 -8 A V S S- 0 0 65 4,-0.1 -1,-0.2 6,-0.0 3,-0.2 -0.896 78.4-173.5-119.0 104.3 108.4 102.5 91.7 4 -7 A P > - 0 0 89 0, 0.0 3,-1.4 0, 0.0 -2,-0.0 0.315 49.1 -11.1 -76.1-154.2 108.0 105.2 94.4 5 -6 A R T 3 S- 0 0 222 1,-0.3 3,-0.1 3,-0.0 0, 0.0 -0.192 124.8 -29.7 -52.2 116.4 108.6 105.1 98.2 6 -5 A G T 3 S+ 0 0 69 1,-0.2 -1,-0.3 -3,-0.2 2,-0.2 0.606 98.3 140.8 53.1 18.2 109.2 101.6 99.5 7 -4 A S < - 0 0 58 -3,-1.4 2,-0.3 2,-0.0 -1,-0.2 -0.532 32.1-162.6 -88.3 157.5 107.1 99.9 96.9 8 -3 A H - 0 0 131 -2,-0.2 2,-0.4 -3,-0.1 161,-0.1 -0.985 11.4-136.7-140.5 151.9 108.0 96.6 95.2 9 -2 A M - 0 0 121 -2,-0.3 2,-0.6 160,-0.1 -6,-0.0 -0.908 18.3-129.4-111.2 134.8 106.9 94.8 92.1 10 -1 A A - 0 0 35 -2,-0.4 2,-0.2 156,-0.0 158,-0.1 -0.724 34.9-169.9 -80.0 122.8 106.2 91.1 91.9 11 0 A S - 0 0 92 -2,-0.6 156,-0.6 156,-0.2 2,-0.2 -0.619 29.1 -89.2-110.9 167.5 108.2 89.6 89.0 12 1 A M B -A 166 0A 89 -2,-0.2 154,-0.2 154,-0.1 2,-0.1 -0.574 48.2-115.9 -72.6 138.6 108.2 86.3 87.3 13 2 A S > - 0 0 26 152,-3.3 3,-1.7 -2,-0.2 152,-0.1 -0.468 14.2-122.5 -74.4 149.2 110.7 83.8 88.8 14 3 A D T 3 S+ 0 0 126 1,-0.3 -1,-0.1 -2,-0.1 152,-0.1 0.610 102.0 85.3 -64.7 -11.2 113.7 82.6 86.8 15 4 A L T > + 0 0 30 122,-0.1 3,-1.8 150,-0.1 147,-0.3 0.736 65.0 109.9 -60.5 -23.8 112.3 79.1 87.4 16 5 A V T < S+ 0 0 22 -3,-1.7 147,-0.2 1,-0.3 3,-0.1 -0.288 80.5 16.7 -62.7 139.5 110.1 79.6 84.4 17 6 A N T 3 S+ 0 0 132 145,-3.5 2,-0.3 1,-0.3 -1,-0.3 0.432 107.0 103.7 75.8 4.5 111.0 77.5 81.3 18 7 A K S < S- 0 0 97 -3,-1.8 144,-2.7 144,-0.3 -1,-0.3 -0.738 83.7 -86.0-108.5 161.8 113.1 75.1 83.4 19 8 A K B -B 161 0A 170 -2,-0.3 142,-0.2 142,-0.2 -1,-0.1 -0.379 53.4 -96.2 -61.8 140.7 112.4 71.6 84.7 20 9 A F - 0 0 17 140,-2.6 2,-1.8 1,-0.1 3,-0.3 -0.460 35.8-134.4 -57.1 121.6 110.4 71.5 87.9 21 10 A P + 0 0 50 0, 0.0 -1,-0.1 0, 0.0 30,-0.1 -0.485 46.5 152.4 -86.3 71.2 113.1 71.0 90.6 22 11 A A > + 0 0 9 -2,-1.8 3,-2.0 1,-0.2 28,-0.2 0.829 16.0 167.8 -68.7 -33.5 111.5 68.2 92.6 23 12 A G T 3 S- 0 0 50 -3,-0.3 28,-0.3 1,-0.3 -1,-0.2 -0.257 71.2 -44.5 50.7-136.7 114.7 66.7 93.8 24 13 A D T 3 S+ 0 0 149 26,-0.1 -1,-0.3 27,-0.1 -2,-0.1 0.113 97.5 138.5-106.3 19.9 113.9 64.2 96.6 25 14 A Y < - 0 0 90 -3,-2.0 25,-2.2 24,-0.1 26,-0.5 -0.338 31.1-169.2 -69.2 146.8 111.4 66.5 98.3 26 15 A K E -C 49 0A 102 23,-0.2 2,-0.3 24,-0.1 23,-0.2 -0.948 8.5-158.0-134.3 152.4 108.2 65.1 99.7 27 16 A F E -C 48 0A 0 21,-2.7 21,-3.1 -2,-0.3 2,-0.4 -0.896 10.1-138.7-125.1 161.7 104.9 66.4 101.0 28 17 A Q E +CD 47 127A 42 99,-1.5 99,-2.8 -2,-0.3 2,-0.3 -0.926 24.8 163.5-115.0 146.2 102.2 65.0 103.2 29 18 A Y E -C 46 0A 20 17,-1.8 17,-2.7 -2,-0.4 2,-0.5 -0.977 30.5-130.8-149.4 160.6 98.4 65.4 102.9 30 19 A I - 0 0 6 95,-0.4 95,-0.3 75,-0.3 12,-0.2 -0.972 30.8-123.7-113.4 128.5 95.3 63.8 104.2 31 20 A A - 0 0 13 10,-1.4 2,-0.4 -2,-0.5 93,-0.1 -0.207 17.9-153.2 -67.0 157.6 92.6 62.7 101.7 32 21 A I + 0 0 13 80,-0.0 88,-2.1 11,-0.0 2,-0.3 -0.998 17.5 172.8-131.5 137.3 89.0 63.9 101.9 33 22 A S - 0 0 27 -2,-0.4 86,-0.2 86,-0.2 6,-0.1 -0.997 35.5-149.9-148.8 139.9 86.1 62.0 100.5 34 23 A Q S S+ 0 0 151 -2,-0.3 2,-0.4 2,-0.1 3,-0.4 0.757 95.8 55.4 -75.7 -27.3 82.3 62.3 100.5 35 24 A S S S+ 0 0 86 1,-0.2 -1,-0.1 2,-0.1 0, 0.0 -0.916 123.3 5.3-108.3 133.3 82.1 58.5 100.2 36 25 A D S > S+ 0 0 119 -2,-0.4 3,-1.6 1,-0.1 -1,-0.2 0.916 75.1 165.4 60.9 45.8 83.9 56.5 102.9 37 26 A A T 3 + 0 0 47 -3,-0.4 -1,-0.1 1,-0.3 -4,-0.1 0.648 70.0 58.4 -67.3 -15.6 84.9 59.6 104.8 38 27 A D T 3 S+ 0 0 132 3,-0.0 -1,-0.3 5,-0.0 -2,-0.1 0.320 79.0 121.7 -98.2 9.2 85.8 57.5 107.8 39 28 A S S X S- 0 0 20 -3,-1.6 3,-1.2 1,-0.1 4,-0.1 -0.268 76.8-113.2 -67.2 158.5 88.4 55.4 106.0 40 29 A E G >> S+ 0 0 141 1,-0.3 4,-2.6 2,-0.2 3,-1.7 0.832 116.1 63.6 -61.3 -32.9 92.0 55.4 107.3 41 30 A S G 34 S+ 0 0 61 1,-0.3 -10,-1.4 2,-0.2 -1,-0.3 0.738 103.6 48.4 -65.2 -22.2 93.1 57.2 104.1 42 31 A C G <4 S+ 0 0 4 -3,-1.2 -1,-0.3 -6,-0.2 -2,-0.2 0.283 116.9 42.2-100.0 9.1 90.9 60.2 105.2 43 32 A K T <4 S+ 0 0 90 -3,-1.7 -2,-0.2 1,-0.2 -3,-0.1 0.671 108.2 53.9-117.8 -38.6 92.3 60.2 108.7 44 33 A M S < S- 0 0 94 -4,-2.6 -13,-0.4 1,-0.0 -1,-0.2 -0.833 83.0-111.3-111.2 140.7 96.1 59.7 108.4 45 34 A P - 0 0 44 0, 0.0 2,-0.3 0, 0.0 -15,-0.2 -0.289 27.5-156.9 -65.2 146.6 98.6 61.6 106.3 46 35 A Q E -C 29 0A 76 -17,-2.7 -17,-1.8 -5,-0.1 2,-0.4 -0.904 15.6-121.4-119.7 157.7 100.2 60.0 103.3 47 36 A T E -C 28 0A 81 -2,-0.3 2,-0.4 -19,-0.2 -19,-0.2 -0.800 23.4-169.9-103.2 136.0 103.5 61.0 101.8 48 37 A V E -C 27 0A 26 -21,-3.1 -21,-2.7 -2,-0.4 2,-0.4 -0.992 19.9-133.3-126.3 130.4 103.9 62.1 98.1 49 38 A E E > -C 26 0A 83 -2,-0.4 4,-2.3 -23,-0.2 3,-0.3 -0.681 13.6-140.2 -77.6 129.6 107.1 62.6 96.3 50 39 A W H > S+ 0 0 0 -25,-2.2 4,-2.2 -2,-0.4 5,-0.2 0.879 103.7 56.3 -57.1 -37.3 107.1 65.8 94.3 51 40 A S H > S+ 0 0 44 -26,-0.5 4,-2.3 -28,-0.3 -1,-0.2 0.886 108.3 46.7 -62.3 -38.9 108.8 64.1 91.4 52 41 A K H > S+ 0 0 110 -3,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.902 109.7 52.8 -71.3 -42.5 106.1 61.4 91.3 53 42 A L H X S+ 0 0 9 -4,-2.3 4,-0.6 1,-0.2 -2,-0.2 0.934 114.5 43.1 -55.6 -46.8 103.3 64.0 91.4 54 43 A I H >< S+ 0 0 13 -4,-2.2 3,-0.6 1,-0.2 106,-0.2 0.902 114.4 47.9 -70.7 -41.2 104.8 65.9 88.5 55 44 A S H 3< S+ 0 0 93 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.833 114.6 47.0 -69.8 -30.4 105.7 62.8 86.3 56 45 A E H 3< S+ 0 0 130 -4,-2.2 2,-0.4 -5,-0.2 -1,-0.2 0.531 110.0 57.7 -88.8 -6.5 102.3 61.3 86.8 57 46 A N << - 0 0 30 -4,-0.6 103,-0.3 -3,-0.6 3,-0.2 -0.971 62.5-158.6-133.4 120.6 100.3 64.5 86.0 58 47 A K S S+ 0 0 131 -2,-0.4 101,-3.1 1,-0.2 2,-0.4 0.817 84.9 29.6 -66.5 -35.1 100.6 66.5 82.8 59 48 A K E S+E 158 0A 28 99,-0.2 36,-2.7 34,-0.1 37,-1.4 -0.942 70.3 173.1-135.7 115.2 99.3 69.8 84.2 60 49 A V E -Ef 157 96A 0 97,-2.7 97,-3.0 -2,-0.4 2,-0.5 -0.970 17.5-157.8-126.6 130.3 99.7 70.9 87.8 61 50 A I E -Ef 156 97A 0 35,-2.8 37,-3.2 -2,-0.4 2,-0.4 -0.914 14.6-172.9-101.2 131.7 98.9 74.1 89.6 62 51 A I E +Ef 155 98A 0 93,-2.7 93,-2.5 -2,-0.5 2,-0.4 -0.993 4.6 179.6-125.4 129.8 100.8 74.8 92.8 63 52 A T E -Ef 154 99A 0 35,-3.0 37,-3.1 -2,-0.4 2,-0.3 -0.994 13.4-149.5-132.7 131.6 100.1 77.7 95.2 64 53 A G E -Ef 153 100A 0 89,-1.9 89,-1.3 -2,-0.4 37,-0.2 -0.751 10.9-172.3 -98.4 144.8 101.8 78.4 98.4 65 54 A A - 0 0 0 35,-2.7 85,-0.4 -2,-0.3 37,-0.3 -0.997 24.4-135.3-135.3 141.4 100.3 80.2 101.5 66 55 A P S S+ 0 0 8 0, 0.0 84,-0.4 0, 0.0 2,-0.3 0.828 84.2 9.5 -63.2 -37.7 102.0 81.4 104.7 67 56 A A > - 0 0 11 82,-0.1 3,-2.3 34,-0.1 6,-0.2 -0.860 66.6-125.7-158.0 113.7 99.5 80.1 107.2 68 57 A A T 3 S+ 0 0 15 -2,-0.3 40,-0.1 1,-0.3 39,-0.0 -0.317 102.8 14.4 -48.8 134.0 96.4 77.8 107.3 69 58 A F T 3 S+ 0 0 113 1,-0.3 -1,-0.3 39,-0.1 39,-0.0 0.326 92.4 134.3 75.3 -4.2 93.5 79.7 108.9 70 59 A S <> - 0 0 33 -3,-2.3 4,-2.6 1,-0.1 -1,-0.3 -0.444 66.1-111.2 -75.2 155.4 95.2 83.1 108.6 71 60 A P H >>S+ 0 0 98 0, 0.0 4,-3.0 0, 0.0 5,-0.6 0.899 110.2 40.6 -57.4 -55.1 92.9 85.9 107.2 72 61 A T H >>S+ 0 0 30 100,-0.3 5,-1.8 1,-0.2 4,-1.4 0.929 119.4 46.2 -64.2 -44.1 94.5 86.7 103.8 73 62 A C H 4>S+ 0 0 0 -6,-0.2 5,-2.3 3,-0.2 -1,-0.2 0.916 120.3 39.5 -60.0 -43.8 95.1 83.0 103.0 74 63 A T H <5S+ 0 0 31 -4,-2.6 -2,-0.2 -7,-0.2 -1,-0.2 0.872 126.7 28.0 -80.5 -39.3 91.6 82.0 104.1 75 64 A V H <5S+ 0 0 110 -4,-3.0 -3,-0.2 -5,-0.3 -2,-0.1 0.883 132.9 19.8 -92.8 -41.4 89.4 84.8 102.8 76 65 A S T <>> S+ 0 0 45 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.852 95.7 59.3 -54.5 -33.4 88.7 80.3 98.1 80 69 A G H <> S+ 0 0 17 -3,-0.7 4,-2.1 1,-0.2 -2,-0.2 0.885 104.0 50.1 -60.2 -40.4 89.3 81.4 94.4 81 70 A Y H < S+ 0 0 37 -4,-1.7 3,-0.8 1,-0.2 4,-0.4 0.925 111.8 52.2 -67.5 -42.6 88.3 76.1 95.2 83 72 A N H 3< S+ 0 0 130 -4,-2.8 3,-0.3 1,-0.2 4,-0.3 0.879 116.8 38.3 -59.9 -40.6 85.7 78.2 93.3 84 73 A Y H 3X S+ 0 0 63 -4,-2.1 4,-2.9 -5,-0.2 -1,-0.2 0.448 86.7 103.9 -90.9 -0.8 87.4 77.7 89.9 85 74 A L H S+ 0 0 103 -4,-0.4 4,-3.1 -3,-0.3 5,-0.3 0.919 114.6 47.4 -59.9 -43.7 85.7 72.4 88.3 87 76 A E H >>S+ 0 0 83 -4,-0.3 4,-2.7 2,-0.2 5,-1.3 0.912 111.7 50.7 -63.5 -43.5 86.5 74.9 85.5 88 77 A L H X5S+ 0 0 0 -4,-2.9 6,-2.6 3,-0.2 4,-0.6 0.923 118.0 38.3 -58.3 -46.9 90.3 74.3 85.8 89 78 A V H <5S+ 0 0 33 -4,-2.6 4,-0.3 4,-0.2 -2,-0.2 0.935 126.3 34.4 -72.8 -46.9 89.8 70.5 85.7 90 79 A K H <5S+ 0 0 149 -4,-3.1 -3,-0.2 -5,-0.2 -2,-0.2 0.795 133.4 22.0 -82.5 -30.5 87.1 70.3 83.1 91 80 A E H <5S+ 0 0 144 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.1 0.738 127.9 39.6-110.0 -31.2 88.0 73.2 80.8 92 81 A K S < - 0 0 88 1,-0.1 4,-2.3 23,-0.1 3,-0.2 -0.262 39.4-116.3 -62.6 151.3 100.8 70.1 110.0 105 94 A P H > S+ 0 0 19 0, 0.0 4,-2.0 0, 0.0 -75,-0.3 0.752 112.8 56.2 -68.3 -24.2 98.7 67.9 107.7 106 95 A F H > S+ 0 0 106 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.917 109.9 45.4 -68.5 -44.6 95.8 67.6 110.2 107 96 A A H > S+ 0 0 27 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.917 112.6 52.2 -64.0 -41.7 95.5 71.4 110.4 108 97 A N H X S+ 0 0 1 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.906 110.2 47.6 -59.7 -43.5 95.7 71.6 106.6 109 98 A Q H X S+ 0 0 24 -4,-2.0 4,-2.7 2,-0.2 -1,-0.2 0.914 111.8 49.4 -64.8 -42.6 92.9 69.0 106.1 110 99 A A H X S+ 0 0 48 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.878 111.4 50.7 -63.9 -36.5 90.7 70.8 108.6 111 100 A W H X S+ 0 0 0 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.954 109.8 49.2 -63.2 -51.4 91.4 74.1 106.8 112 101 A A H <>S+ 0 0 1 -4,-2.7 5,-2.5 1,-0.2 3,-0.4 0.922 111.8 49.2 -53.2 -48.4 90.5 72.5 103.4 113 102 A K H ><5S+ 0 0 101 -4,-2.7 3,-1.7 1,-0.2 -1,-0.2 0.913 108.8 52.6 -59.2 -41.9 87.3 71.1 104.9 114 103 A S H 3<5S+ 0 0 74 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.780 106.8 54.6 -64.7 -26.1 86.4 74.6 106.4 115 104 A L T 3<5S- 0 0 31 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.371 126.7-100.4 -89.1 2.5 86.9 76.0 102.9 116 105 A G T < 5 + 0 0 36 -3,-1.7 2,-0.5 1,-0.3 -3,-0.2 0.637 65.0 157.2 90.6 15.9 84.4 73.6 101.5 117 106 A V < + 0 0 8 -5,-2.5 -1,-0.3 -6,-0.2 3,-0.1 -0.647 9.4 171.7 -73.8 123.6 86.7 71.0 99.9 118 107 A K + 0 0 127 -2,-0.5 2,-0.3 1,-0.3 -1,-0.2 0.572 64.0 25.2-106.7 -17.2 84.7 67.8 99.7 119 108 A D - 0 0 56 -86,-0.2 3,-0.4 -85,-0.1 -1,-0.3 -0.964 53.9-156.0-156.4 131.0 87.1 65.6 97.7 120 109 A T + 0 0 9 -88,-2.1 -87,-0.1 -2,-0.3 -1,-0.0 0.202 63.7 110.4 -95.8 16.4 90.9 65.6 97.2 121 110 A T S S+ 0 0 76 -89,-0.2 -1,-0.2 1,-0.2 3,-0.1 0.921 100.6 10.3 -55.2 -45.5 90.9 63.8 93.8 122 111 A H S S+ 0 0 68 -3,-0.4 -25,-2.3 1,-0.2 2,-0.4 0.404 129.6 54.0-116.9 -2.8 92.1 67.0 92.0 123 112 A I E + g 0 97A 2 -4,-0.3 2,-0.4 -27,-0.2 -25,-0.2 -0.991 59.8 178.8-136.6 129.5 92.9 69.3 94.9 124 113 A K E - g 0 98A 22 -27,-2.4 -25,-2.7 -2,-0.4 2,-0.9 -0.993 25.5-141.3-133.1 135.6 95.3 68.5 97.8 125 114 A F E - g 0 99A 8 -2,-0.4 -95,-0.4 -95,-0.3 2,-0.2 -0.822 33.6-158.7 -96.1 101.8 96.4 70.6 100.7 126 115 A A E - g 0 100A 0 -27,-2.4 -25,-2.3 -2,-0.9 2,-0.5 -0.561 13.1-143.1 -90.7 141.4 100.1 69.7 101.1 127 116 A S E -Dg 28 101A 3 -99,-2.8 -99,-1.5 -2,-0.2 -25,-0.2 -0.901 7.4-167.2 -97.9 129.2 102.4 70.1 104.1 128 117 A D > - 0 0 2 -27,-2.6 3,-2.5 -2,-0.5 -101,-0.1 -0.812 25.7-141.2-112.6 83.8 106.0 71.1 103.3 129 118 A P G > S- 0 0 68 0, 0.0 3,-1.3 0, 0.0 4,-0.2 -0.198 79.5 -0.9 -58.6 131.0 107.5 70.3 106.8 130 119 A G G 3 S- 0 0 64 -28,-0.4 -28,-0.1 1,-0.3 -27,-0.0 0.608 114.7 -87.1 66.6 12.4 110.1 72.8 107.8 131 120 A C G <> S+ 0 0 0 -3,-2.5 4,-2.8 -30,-0.1 5,-0.3 0.737 83.4 149.2 62.8 25.2 109.6 74.7 104.6 132 121 A A H <> + 0 0 44 -3,-1.3 4,-1.4 1,-0.2 -2,-0.1 0.932 68.7 36.3 -60.6 -53.1 112.2 72.5 102.9 133 122 A F H > S+ 0 0 0 2,-0.2 4,-0.9 -107,-0.2 -1,-0.2 0.930 118.6 50.3 -65.5 -45.4 110.8 72.4 99.4 134 123 A T H >4>S+ 0 0 0 1,-0.2 5,-2.2 2,-0.2 3,-0.6 0.879 110.2 49.7 -64.0 -39.7 109.6 76.0 99.4 135 124 A K H ><5S+ 0 0 93 -4,-2.8 3,-1.1 1,-0.2 -1,-0.2 0.857 103.3 63.0 -63.3 -34.1 113.0 77.3 100.7 136 125 A S H 3<5S+ 0 0 53 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.761 108.6 39.6 -65.5 -26.0 114.7 75.3 97.9 137 126 A I T <<5S- 0 0 18 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.342 115.9-113.9-103.8 5.4 112.9 77.3 95.2 138 127 A G T < 5S+ 0 0 35 -3,-1.1 -3,-0.2 -4,-0.3 -2,-0.1 0.670 83.0 119.3 76.3 19.4 113.4 80.6 97.1 139 128 A F < + 0 0 9 -5,-2.2 12,-2.3 -6,-0.2 -4,-0.2 0.081 42.7 123.0-103.2 23.0 109.7 81.2 97.8 140 129 A E E -I 150 0B 63 -6,-0.3 2,-0.4 10,-0.2 10,-0.2 -0.272 53.4-139.2 -82.4 167.4 109.9 81.1 101.6 141 130 A L E -I 149 0B 52 8,-3.2 8,-2.8 10,-0.2 2,-0.3 -0.969 13.2-140.8-128.9 116.5 108.9 83.8 104.1 142 131 A A E +I 148 0B 66 -2,-0.4 6,-0.2 6,-0.2 3,-0.1 -0.588 22.3 175.0 -73.9 129.1 111.1 84.4 107.1 143 132 A V E - 0 0 66 4,-2.5 5,-0.1 -2,-0.3 -1,-0.1 0.355 53.1 -77.2-119.1 5.6 109.1 85.0 110.3 144 133 A G E > S+I 147 0B 36 3,-0.7 3,-1.6 0, 0.0 -1,-0.2 -0.022 100.7 40.9 116.3 144.6 111.8 85.3 112.9 145 134 A D T 3 S- 0 0 170 1,-0.3 3,-0.1 -3,-0.1 -3,-0.0 0.811 128.1 -54.4 59.8 36.4 114.3 83.2 114.9 146 135 A G T 3 S+ 0 0 65 1,-0.3 2,-0.4 0, 0.0 -1,-0.3 0.538 104.1 132.7 78.1 6.5 115.2 80.8 112.1 147 136 A V E < -I 144 0B 73 -3,-1.6 -4,-2.5 -16,-0.0 -3,-0.7 -0.771 36.4-165.5 -93.9 135.5 111.5 79.9 111.4 148 137 A Y E -I 142 0B 80 -2,-0.4 2,-0.2 -6,-0.2 -6,-0.2 -0.976 9.7-175.2-123.1 132.0 110.2 79.9 107.8 149 138 A W E -I 141 0B 98 -8,-2.8 -8,-3.2 -2,-0.4 2,-0.1 -0.670 43.4 -89.0-104.2 169.4 106.7 79.8 106.5 150 139 A S E -I 140 0B 0 -85,-0.4 -10,-0.2 -84,-0.4 -1,-0.1 -0.477 39.8-132.1 -67.2 150.9 105.8 79.6 102.8 151 140 A G - 0 0 4 -12,-2.3 2,-0.6 -2,-0.1 -10,-0.2 -0.157 36.9 -88.5 -77.6-168.7 105.5 82.9 101.1 152 141 A R S S+ 0 0 3 16,-0.2 16,-3.2 -87,-0.2 2,-0.3 -0.953 70.2 134.1-107.7 122.7 102.5 83.5 98.9 153 142 A W E -EH 64 167A 0 -89,-1.3 -89,-1.9 -2,-0.6 2,-0.3 -0.948 38.8-141.6-156.9 167.5 103.1 82.3 95.4 154 143 A A E -EH 63 166A 0 12,-2.2 12,-2.0 -2,-0.3 2,-0.3 -0.986 14.0-176.5-142.5 154.6 101.7 80.3 92.5 155 144 A M E -EH 62 165A 0 -93,-2.5 -93,-2.7 -2,-0.3 2,-0.4 -0.994 13.9-153.1-148.8 146.2 103.2 78.0 89.9 156 145 A V E -EH 61 164A 0 8,-2.4 7,-2.3 -2,-0.3 8,-1.3 -0.995 11.8-167.8-122.3 132.9 102.1 76.1 86.8 157 146 A V E -EH 60 162A 2 -97,-3.0 -97,-2.7 -2,-0.4 2,-0.5 -0.983 4.1-175.7-122.8 121.6 103.9 72.9 85.7 158 147 A E E > S-EH 59 161A 55 3,-2.9 3,-2.1 -2,-0.5 -99,-0.2 -0.975 72.7 -19.4-122.6 122.4 103.2 71.4 82.3 159 148 A N T 3 S- 0 0 106 -101,-3.1 -1,-0.2 -2,-0.5 -101,-0.1 0.869 128.9 -51.2 49.0 41.5 104.8 68.1 81.3 160 149 A G T 3 S+ 0 0 20 -103,-0.3 -140,-2.6 -102,-0.2 2,-0.4 0.429 117.2 112.2 82.5 -1.2 107.4 68.6 84.0 161 150 A I E < S-BH 19 158A 60 -3,-2.1 -3,-2.9 -142,-0.2 2,-0.6 -0.898 70.2-123.7-109.0 132.9 108.3 72.1 82.9 162 151 A V E + H 0 157A 0 -144,-2.7 -145,-3.5 -2,-0.4 -144,-0.3 -0.616 34.1 169.5 -71.7 115.6 107.6 75.2 85.0 163 152 A T E + 0 0 45 -7,-2.3 2,-0.3 -2,-0.6 -1,-0.2 0.607 67.7 21.6-103.3 -15.6 105.6 77.5 82.7 164 153 A Y E + H 0 156A 5 -8,-1.3 -8,-2.4 -149,-0.1 -1,-0.3 -0.977 63.3 157.9-151.4 137.2 104.6 80.1 85.3 165 154 A A E + H 0 155A 0 -2,-0.3 -152,-3.3 -10,-0.2 2,-0.3 -0.822 9.8 144.5-164.0 124.7 106.1 81.0 88.7 166 155 A A E -AH 12 154A 2 -12,-2.0 -12,-2.2 -2,-0.3 2,-0.3 -0.971 24.5-152.2-162.4 143.3 105.8 84.1 90.8 167 156 A K E - H 0 153A 89 -156,-0.6 -14,-0.3 -2,-0.3 -156,-0.2 -0.877 27.7-104.9-119.6 154.0 105.6 85.2 94.5 168 157 A E - 0 0 4 -16,-3.2 -16,-0.2 -2,-0.3 -159,-0.1 -0.432 12.4-149.7 -68.3 146.8 104.1 88.2 96.3 169 158 A T S S+ 0 0 50 1,-0.2 -1,-0.1 -161,-0.1 3,-0.1 0.744 102.6 32.8 -83.6 -28.5 106.4 90.9 97.5 170 159 A N S >> S+ 0 0 76 1,-0.1 4,-3.0 -162,-0.1 3,-1.3 -0.654 73.3 169.1-124.2 74.1 103.9 91.5 100.3 171 160 A P T 34 + 0 0 18 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.799 70.0 65.7 -63.5 -29.3 102.4 88.1 101.0 172 161 A G T 34 S+ 0 0 49 1,-0.2 -100,-0.3 -3,-0.1 -99,-0.1 0.821 124.1 9.3 -59.4 -33.1 100.7 89.2 104.2 173 162 A T T <4 S+ 0 0 106 -3,-1.3 2,-0.4 -101,-0.1 -1,-0.2 0.669 110.2 83.3-121.8 -27.6 98.3 91.5 102.4 174 163 A D < + 0 0 49 -4,-3.0 2,-0.4 -22,-0.0 -6,-0.1 -0.691 36.2 176.1 -94.7 134.8 98.6 91.0 98.6 175 164 A V + 0 0 38 -2,-0.4 -22,-0.0 2,-0.0 -3,-0.0 -0.827 46.2 108.5-127.0 92.0 97.0 88.4 96.4 176 165 A T S > S+ 0 0 67 -2,-0.4 3,-1.7 3,-0.1 6,-0.5 0.511 80.6 22.9-126.3 -85.0 98.1 89.3 92.9 177 166 A V T 3 S+ 0 0 24 1,-0.3 -11,-0.1 5,-0.1 -24,-0.1 0.742 128.0 51.8 -63.4 -21.0 100.5 87.1 91.0 178 167 A S T 3 S+ 0 0 0 -25,-0.1 -1,-0.3 -26,-0.1 -25,-0.2 0.482 88.1 113.6 -91.5 -3.3 99.5 84.2 93.3 179 168 A S S <> S- 0 0 10 -3,-1.7 4,-2.1 1,-0.1 5,-0.1 -0.304 77.2-123.4 -71.2 151.8 95.8 84.7 92.6 180 169 A V H > S+ 0 0 2 -103,-0.3 4,-2.9 1,-0.2 5,-0.2 0.830 113.4 60.0 -60.6 -31.0 93.8 82.1 90.8 181 170 A E H > S+ 0 0 108 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.911 105.8 45.5 -64.7 -43.6 92.9 84.9 88.2 182 171 A S H 4 S+ 0 0 36 -6,-0.5 4,-0.3 2,-0.2 -2,-0.2 0.887 113.0 51.1 -67.2 -37.4 96.6 85.4 87.4 183 172 A V H >< S+ 0 0 0 -4,-2.1 3,-2.0 1,-0.2 -2,-0.2 0.948 107.7 52.7 -61.6 -46.9 97.1 81.6 87.1 184 173 A L H >< S+ 0 0 34 -4,-2.9 3,-1.2 1,-0.3 -1,-0.2 0.854 104.8 56.3 -55.7 -36.3 94.1 81.4 84.8 185 174 A A T 3< S+ 0 0 78 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.573 108.5 48.7 -73.2 -8.8 95.7 84.1 82.6 186 175 A H T < 0 0 80 -3,-2.0 -1,-0.2 -4,-0.3 -2,-0.2 0.066 360.0 360.0-120.6 24.4 98.8 81.9 82.3 187 176 A L < 0 0 75 -3,-1.2 -1,-0.1 -93,-0.0 -2,-0.1 0.377 360.0 360.0-100.4 360.0 97.2 78.5 81.4